SCHEMBL3592765

SCHEMBL3592765

O=[N+]([O-])c1cnccc1N1CCc2ccccc2C1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.58
MAPK1 P28482 2/20 0.58
TDP1 Q9NUW8 1/20 0.58
PKM P14618 1/20 0.57
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
LMNA P02545 3/20 0.52
NPSR1 Q6W5P4 1/20 0.52
EED O75530 2/20 0.51
ALDH1A1 P00352 1/20 0.47
NUDT1 P36639 1/20 0.47
RAB9A P51151 1/20 0.45
HPGD P15428 1/20 0.45
CYP3A4 P08684 1/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2767612 0.90 MAPT (0.55) MAPTMAPK1TDP1PKMMEN1
SCHEMBL27784865 0.83 MAPT (0.66) MAPTMAPK1TDP1PKMMEN1
SCHEMBL9197156 0.80 ALDH1A1 (0.53) MAPTMAPK1TDP1MEN1KMT2A
SCHEMBL9425659 0.77 MAPT (0.67) MAPTMAPK1TDP1MEN1KMT2A
SCHEMBL6784527 0.76 EED (0.62) MAPTEEDNUDT1CYP3A4
SCHEMBL15771279 0.76 CYP3A4 (0.52) MAPTMAPK1PKMMEN1KMT2A
SCHEMBL1710516 0.76 MAPT (0.65) MAPTMAPK1TDP1PKMMEN1
SCHEMBL6953910 0.75 KMT2A (0.59) MAPTMAPK1TDP1PKMMEN1
SCHEMBL10514216 0.75 MAPT (0.44) MAPTMAPK1MEN1KMT2ALMNA
SCHEMBL1735993 0.75 NPC1 (0.69) MAPTMAPK1TDP1MEN1KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1784403-B1 PYRROLO[3,2-B]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORP (KR) 2013-07-17 EP disclosed
US-7642269-B2 Pyrrolo[3,2-B]pyridine derivatives and processes for the preparation thereof YUHAN CORPORATION (KR) 2010-01-05 US disclosed
US-20070213358-A1 PYRROLO[3,2-B]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 2007-09-13 US disclosed
EP-1784403-A1 PYRROLO[3,2-B]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF Yuhan Corporation (KR) 2007-05-16 EP disclosed
WO-2007001139-A1 A COMPOSITION FOR TREATING OR PREVENTING A CANCER COMPRISING PYRROLOPYRIDINE DERIVATIVES YUHAN CORPORATION (KR) 2007-01-04 WO disclosed
WO-2006038773-A1 PYRROLO[3,2-B]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 2006-04-13 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070213358-A1 PYRROLO[3,2-B]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF PGA5, ATP6AP1, PPOX MAPT 3810/4885MAPK1 1896/4885TDP1 3248/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.